#include #include #include #include #include #include #include #include "thread_mem.h" #include "common.h" #ifdef __GNUC__ #define LIKELY(x) __builtin_expect((x), 1) #define UNLIKELY(x) __builtin_expect((x), 0) #else #define LIKELY(x) (x) #define UNLIKELY(x) (x) #endif #define SIMD_WIDTH 16 static const uint16_t h_vec_int_mask[SIMD_WIDTH][SIMD_WIDTH] = { {0xffff, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0}, {0xffff, 0xffff, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0}, {0xffff, 0xffff, 0xffff, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0}, {0xffff, 0xffff, 0xffff, 0xffff, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0}, {0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0}, {0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0}, {0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0, 0, 0, 0, 0, 0, 0, 0, 0}, {0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0, 0, 0, 0, 0, 0, 0, 0}, {0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0, 0, 0, 0, 0, 0, 0}, {0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0, 0, 0, 0, 0, 0}, {0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0, 0, 0, 0, 0}, {0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0, 0, 0, 0}, {0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0, 0, 0}, {0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0, 0}, {0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0}, {0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff, 0xffff}}; // #define permute_mask _MM_SHUFFLE(0, 1, 2, 3) #define permute_mask 27 // 初始化变量 #define SIMD_INIT \ int oe_del = o_del + e_del, oe_ins = o_ins + e_ins; \ __m256i zero_vec; \ __m256i max_vec; \ __m256i oe_del_vec; \ __m256i oe_ins_vec; \ __m256i e_del_vec; \ __m256i e_ins_vec; \ __m256i h_vec_mask[SIMD_WIDTH]; \ zero_vec = _mm256_setzero_si256(); \ oe_del_vec = _mm256_set1_epi16(-oe_del); \ oe_ins_vec = _mm256_set1_epi16(-oe_ins); \ e_del_vec = _mm256_set1_epi16(-e_del); \ e_ins_vec = _mm256_set1_epi16(-e_ins); \ __m256i match_sc_vec = _mm256_set1_epi16(base_match_score); \ __m256i mis_sc_vec = _mm256_set1_epi16(-base_mis_score); \ __m256i amb_sc_vec = _mm256_set1_epi16(-1); \ __m256i amb_vec = _mm256_set1_epi16(4); \ for (i = 0; i < SIMD_WIDTH; ++i) \ h_vec_mask[i] = _mm256_loadu_si256((__m256i *)(&h_vec_int_mask[i])); /* * e 表示当前ref的碱基被删除 * f 表示当前seq的碱基插入 * m 表示当前碱基匹配(可以相等,也可以不想等) * h 表示最大值 */ // load向量化数据 #define SIMD_LOAD \ __m256i m1 = _mm256_loadu_si256((__m256i *)(&mA1[j])); \ __m256i e1 = _mm256_loadu_si256((__m256i *)(&eA1[j])); \ __m256i m1j1 = _mm256_loadu_si256((__m256i *)(&mA1[j - 1])); \ __m256i f1j1 = _mm256_loadu_si256((__m256i *)(&fA1[j - 1])); \ __m256i h0j1 = _mm256_loadu_si256((__m256i *)(&hA0[j - 1])); \ __m256i qs_vec = _mm256_loadu_si256((__m256i *)(&seq[j - 1])); \ __m256i ts_vec = _mm256_loadu_si256((__m256i *)(&ref[i])); // 比对ref和seq的序列,计算罚分 #define SIMD_CMP_SEQ \ ts_vec = _mm256_permute4x64_epi64(ts_vec, permute_mask); \ ts_vec = _mm256_shufflelo_epi16(ts_vec, permute_mask); \ ts_vec = _mm256_shufflehi_epi16(ts_vec, permute_mask); \ __m256i match_mask_vec = _mm256_cmpeq_epi16(qs_vec, ts_vec); \ __m256i mis_score_vec = _mm256_andnot_si256(match_mask_vec, mis_sc_vec); \ __m256i score_vec = _mm256_and_si256(match_sc_vec, match_mask_vec); \ score_vec = _mm256_or_si256(score_vec, mis_score_vec); \ __m256i q_amb_mask_vec = _mm256_cmpeq_epi16(qs_vec, amb_vec); \ __m256i t_amb_mask_vec = _mm256_cmpeq_epi16(ts_vec, amb_vec); \ __m256i amb_mask_vec = _mm256_or_si256(q_amb_mask_vec, t_amb_mask_vec); \ score_vec = _mm256_andnot_si256(amb_mask_vec, score_vec); \ __m256i amb_score_vec = _mm256_and_si256(amb_mask_vec, amb_sc_vec); \ score_vec = _mm256_or_si256(score_vec, amb_score_vec); // 向量化计算h, e, f, m #define SIMD_COMPUTE \ __m256i en_vec0 = _mm256_add_epi16(m1, oe_del_vec); \ __m256i en_vec1 = _mm256_add_epi16(e1, e_del_vec); \ __m256i en_vec = _mm256_max_epi16(en_vec0, en_vec1); \ __m256i fn_vec0 = _mm256_add_epi16(m1j1, oe_ins_vec); \ __m256i fn_vec1 = _mm256_add_epi16(f1j1, e_ins_vec); \ __m256i fn_vec = _mm256_max_epi16(fn_vec0, fn_vec1); \ __m256i mn_vec0 = _mm256_add_epi16(h0j1, score_vec); \ __m256i mn_mask = _mm256_cmpgt_epi16(h0j1, zero_vec); \ __m256i mn_vec = _mm256_and_si256(mn_vec0, mn_mask); \ __m256i hn_vec0 = _mm256_max_epi16(en_vec, fn_vec); \ __m256i hn_vec = _mm256_max_epi16(hn_vec0, mn_vec); \ en_vec = _mm256_max_epi16(en_vec, zero_vec); \ fn_vec = _mm256_max_epi16(fn_vec, zero_vec); \ mn_vec = _mm256_max_epi16(mn_vec, zero_vec); \ hn_vec = _mm256_max_epi16(hn_vec, zero_vec); /* int16_t *t_ptr = (int16_t *)&ts_vec; \ fprintf(stderr, "D: %d, ibeg: %d, iend: %d, jbeg: %d, jend: %d, %d %d %d %d %d %d %d %d %d %d %d %d %d %d %d %d \n", \ D, ibeg, iend, beg, end, \ t_ptr[0], t_ptr[1], t_ptr[2], t_ptr[3], \ t_ptr[4], t_ptr[5], t_ptr[6], t_ptr[7], \ t_ptr[8], t_ptr[9], t_ptr[10], t_ptr[11], \ t_ptr[12], t_ptr[13], t_ptr[14], t_ptr[15]); */ // 存储向量化结果 #define SIMD_STORE \ max_vec = _mm256_max_epi16(max_vec, hn_vec); \ _mm256_storeu_si256((__m256i *)&eA2[j], en_vec); \ _mm256_storeu_si256((__m256i *)&fA2[j], fn_vec); \ _mm256_storeu_si256((__m256i *)&mA2[j], mn_vec); \ _mm256_storeu_si256((__m256i *)&hA2[j], hn_vec); // 去除多余的部分 #define SIMD_REMOVE_EXTRA \ en_vec = _mm256_and_si256(en_vec, h_vec_mask[end - j]); \ fn_vec = _mm256_and_si256(fn_vec, h_vec_mask[end - j]); \ mn_vec = _mm256_and_si256(mn_vec, h_vec_mask[end - j]); \ hn_vec = _mm256_and_si256(hn_vec, h_vec_mask[end - j]); // 找最大值和位置 #define SIMD_FIND_MAX \ max_vec = _mm256_max_epu16(max_vec, _mm256_alignr_epi8(max_vec, max_vec, 2)); \ max_vec = _mm256_max_epu16(max_vec, _mm256_alignr_epi8(max_vec, max_vec, 4)); \ max_vec = _mm256_max_epu16(max_vec, _mm256_alignr_epi8(max_vec, max_vec, 6)); \ max_vec = _mm256_max_epu16(max_vec, _mm256_alignr_epi8(max_vec, max_vec, 8)); \ max_vec = _mm256_max_epu16(max_vec, _mm256_permute2x128_si256(max_vec, max_vec, 0x01)); \ int16_t *maxVal = (int16_t *)&max_vec; \ m = maxVal[0]; \ if (m > 0) \ { \ for (j = beg, i = iend; j <= end; j += SIMD_WIDTH, i -= SIMD_WIDTH) \ { \ __m256i h2_vec = _mm256_loadu_si256((__m256i *)(&hA2[j])); \ __m256i vcmp = _mm256_cmpeq_epi16(h2_vec, max_vec); \ uint32_t mask = _mm256_movemask_epi8(vcmp); \ if (mask > 0) \ { \ int pos = SIMD_WIDTH - 1 - ((__builtin_clz(mask)) >> 1); \ mj = j - 1 + pos; \ mi = i - 1 - pos; \ } \ } \ } // 每轮迭代后,交换数组 #define SWAP_DATA_POINTER \ int16_t *tmp = hA0; \ hA0 = hA1; \ hA1 = hA2; \ hA2 = tmp; \ tmp = eA1; \ eA1 = eA2; \ eA2 = tmp; \ tmp = fA1; \ fA1 = fA2; \ fA2 = tmp; \ tmp = mA1; \ mA1 = mA2; \ mA2 = tmp; int ksw_extend_avx2(thread_mem_t *tmem, int qlen, // query length 待匹配段碱基的query长度 const uint8_t *query, // read碱基序列 int tlen, // target length reference的长度 const uint8_t *target, // reference序列 int extend_left, // 是不是向左扩展 int o_del, // deletion 错配开始的惩罚系数 int e_del, // deletion extension的惩罚系数 int o_ins, // insertion 错配开始的惩罚系数 int e_ins, // insertion extension的惩罚系数SIMD_BTYES int base_match_score, // 碱基match时的分数 int base_mis_score, // 碱基mismatch时的惩罚分数(正数) int window_size, // 提前剪枝系数,w =100 匹配位置和beg的最大距离 int end_bonus, // 如果query比对到了最后一个字符,额外奖励分值 int init_score, // 该seed的初始得分(完全匹配query的碱基数) int *_qle, // 匹配得到全局最大得分的碱基在query的位置 int *_tle, // 匹配得到全局最大得分的碱基在reference的位置 int *_gtle, // query全部匹配上的target的长度 int *_gscore, // query的端到端匹配得分 int *_max_off) // 取得最大得分时在query和reference上位置差的 最大值 { int16_t *mA, *hA, *eA, *fA, *mA1, *mA2, *hA0, *hA1, *eA1, *fA1, *hA2, *eA2, *fA2; // hA0保存上上个col的H,其他的保存上个H E F M int16_t *seq, *ref; uint8_t *mem; int16_t *qtmem, *vmem; int seq_size = qlen + SIMD_WIDTH, ref_size = tlen + SIMD_WIDTH; int i, ibeg, iend, D, j, beg, end, max, max_i, max_j, max_ins, max_del, max_ie, gscore, max_off; int Dloop = tlen + qlen; // 循环跳出条件 int span, beg1, end1; // 边界条件计算 int col_size = qlen + 2 + SIMD_WIDTH; int val_mem_size = (col_size * 9 * 2 + 31) >> 5 << 5; // 32字节的整数倍 int mem_size = (seq_size + ref_size) * 2 + val_mem_size; SIMD_INIT; // 初始化simd用的数据 assert(init_score > 0); // allocate memory mem = thread_mem_request(tmem, mem_size); qtmem = (int16_t *)&mem[0]; seq = &qtmem[0]; ref = &qtmem[seq_size]; if (extend_left) { for (i = 0; i < qlen; ++i) seq[i] = query[qlen - 1 - i]; for (i = 0; i < tlen; ++i) ref[i + SIMD_WIDTH - 1] = target[tlen - 1 - i]; } else { for (i = 0; i < qlen; ++i) seq[i] = query[i]; for (i = 0; i < tlen; ++i) ref[i + SIMD_WIDTH - 1] = target[i]; } vmem = &ref[ref_size]; for (i = 0; i < (val_mem_size >> 1); i += SIMD_WIDTH) { _mm256_storeu_si256((__m256i *)&vmem[i], zero_vec); } hA = &vmem[0]; mA = &vmem[col_size * 3]; eA = &vmem[col_size * 5]; fA = &vmem[col_size * 7]; hA0 = &hA[0]; hA1 = &hA[col_size]; hA2 = &hA1[col_size]; mA1 = &mA[0]; mA2 = &mA[col_size]; eA1 = &eA[0]; eA2 = &eA[col_size]; fA1 = &fA[0]; fA2 = &fA[col_size]; // adjust $window_size if it is too large // get the max score max = base_match_score; max_ins = (int)((double)(qlen * max + end_bonus - o_ins) / e_ins + 1.); max_ins = max_ins > 1 ? max_ins : 1; window_size = window_size < max_ins ? window_size : max_ins; max_del = (int)((double)(qlen * max + end_bonus - o_del) / e_del + 1.); max_del = max_del > 1 ? max_del : 1; window_size = window_size < max_del ? window_size : max_del; // TODO: is this necessary? if (tlen < qlen) window_size = MIN(tlen - 1, window_size); // DP loop max = init_score, max_i = max_j = -1; max_ie = -1, gscore = -1; max_off = 0; beg = 1; end = qlen; // init init_score hA0[0] = init_score; // 左上角 fA1[1] = MAX(0, init_score - (o_ins + e_ins)); eA2[0] = init_score; hA1[1] = fA1[1]; if (qlen == 0 || tlen == 0) Dloop = 0; // 防止意外情况 if (window_size >= qlen) { max_ie = 0; gscore = 0; } // fprintf(stderr, "qlen:%d, tlen:%d\n", qlen, tlen); #ifdef DEBUG_OUT int dii, djj; int16_t ins[tlen + 1][qlen + 2]; int16_t del[tlen + 1][qlen + 2]; int16_t score[tlen + 1][qlen + 2]; for (dii = 0; dii <= tlen; ++dii) { for (djj = 0; djj <= qlen; ++djj) { ins[dii][djj] = del[dii][djj] = score[dii][djj] = 0; } } ins[0][0] = del[0][0] = score[0][0] = init_score; ins[0][1] = MAX(0, init_score - (o_ins + e_ins)); del[1][0] = MAX(0, init_score - (o_del + e_del)); score[0][1] = ins[0][1]; score[1][0] = del[1][0]; // fprintf(stderr, "%d %d\n", del[1][0], score[1][0]); #endif for (D = 1; LIKELY(D < Dloop); ++D) { if (D < tlen) beg1 = 1; else beg1 = D - tlen + 1; if (D < qlen) end1 = D; // 闭区间 else end1 = qlen; // beg1 = MAX(D - window_size, beg1); // end1 = MIN(D + window_size, end1); // beg = MAX(beg1, beg); // end = MIN(end1, end); // if (beg > end) // break; beg = beg1; end = end1; iend = D - beg; // ref开始计算的位置,倒序 span = end - beg; ibeg = iend - span; // 0开始的ref索引位置 // fprintf(stderr, "D:%d, jbeg:%d, jend:%d, ibeg:%d, iend:%d\n", D, beg, end, ibeg, iend); // 每一轮需要记录的数据 int m = 0, mj = -1, mi = -1; max_vec = zero_vec; // 处理左边界 if (beg == 1) { hA0[0] = eA2[0]; mA1[0] = 0; eA1[0] = MAX(0, init_score - (o_del + e_del * (iend + 1))); #ifdef DEBUG_OUT del[iend + 1][0] = eA1[0]; score[iend + 1][0] = eA1[0]; #endif } #ifdef DEBUG_OUT // fprintf(stderr, "eA1: %d\n", eA1[0]); // for (djj = beg - 1; djj < end; ++djj) //{ // fprintf(stderr, "%d ", hA0[djj]); //} // fprintf(stderr, "\n"); #endif for (j = beg, i = iend; j <= end + 1 - SIMD_WIDTH; j += SIMD_WIDTH, i -= SIMD_WIDTH) { // 取数据 SIMD_LOAD; // 比对seq,计算罚分 SIMD_CMP_SEQ; // 计算 SIMD_COMPUTE; // 存储结果 SIMD_STORE; } // 剩下的计算单元 if (j <= end) { // 取数据 SIMD_LOAD; // 比对seq,计算罚分 SIMD_CMP_SEQ; // 计算 SIMD_COMPUTE; // 去除多余计算的部分 SIMD_REMOVE_EXTRA; // 存储结果 SIMD_STORE; } // 处理上边界 if (ibeg == 0) { fA2[end + 1] = MAX(0, init_score - (o_ins + e_ins * (end + 1))); hA2[end + 1] = fA2[end + 1]; mA2[end + 1] = 0; #ifdef DEBUG_OUT ins[0][end + 1] = fA2[end + 1]; score[0][end + 1] = fA2[end + 1]; #endif } SIMD_FIND_MAX; #ifdef DEBUG_OUT for (djj = beg; djj <= end; ++djj) { dii = D - djj + 1; // fprintf(stderr, "dii:%d, djj:%d, ", dii, djj); ins[dii][djj] = fA2[djj]; del[dii][djj] = eA2[djj]; score[dii][djj] = hA2[djj]; } // fprintf(stderr, "\n"); // fprintf(stderr, "%d, %d\n", hA2[0], hA2[1]); #endif // 注意最后跳出循环j的值 j = end + 1; if (j == qlen + 1) { max_ie = gscore > hA2[qlen] ? max_ie : ibeg; gscore = gscore > hA2[qlen] ? gscore : hA2[qlen]; } if (m > max) { max = m, max_i = mi, max_j = mj; max_off = max_off > abs(mj - mi) ? max_off : abs(mj - mi); } // 调整计算的边界 // for (j = beg; LIKELY(j <= end); ++j) //{ // int has_val = hA1[j - 1] | hA2[j]; // if (has_val) // break; //} // beg = j; // for (j = end + 1; LIKELY(j >= beg); --j) //{ // int has_val = hA1[j - 1] | hA2[j]; // if (has_val) // break; //} // end = j + 1 <= qlen ? j + 1 : qlen; // beg = 0; // end = qlen; // uncomment this line for debugging // swap m, h, e, f SWAP_DATA_POINTER; } #ifdef DEBUG_OUT for (dii = 0; dii <= tlen; ++dii) { for (djj = 0; djj <= qlen; ++djj) { fprintf(score_f_arr[1], "%-4d", score[dii][djj]); fprintf(ins_ext_f_arr[1], "%-4d", ins[dii][djj]); fprintf(del_ext_f_arr[1], "%-4d", del[dii][djj]); } fprintf(score_f_arr[1], "\n"); fprintf(ins_ext_f_arr[1], "\n"); fprintf(del_ext_f_arr[1], "\n"); } #endif // free(mem); thread_mem_release(tmem, mem_size); if (_qle) *_qle = max_j + 1; if (_tle) *_tle = max_i + 1; if (_gtle) *_gtle = max_ie + 1; if (_gscore) *_gscore = gscore; if (_max_off) *_max_off = max_off; return max; }